(Q105275957)

English

3,5,5-trimethyl-4-[(3E,5E,7E,9E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethylcyclohex-2-en-1-yl)octadeca-3,5,7,9,11,13,15,17-octaen-1-yn-1-yl]cyclohex-3-en-1-ol

group of stereoisomers with the chemical formula C₄₀H₅₄O

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instance of

group of stereoisomers

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550.4174663480001 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₄₀H₅₄O

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canonical SMILES

OC1CC(=C(C#CC(=CC=CC(=CC=CC=C(C=CC=C(C=CC2C(=CCCC2(C)C)C)C)C)C)C)C(C)(C)C1)C

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isomeric SMILES

CC(C=CC1C(C)=CCCC1(C)C)=CC=CC(C)=C/C=C/C=C(C)/C=C/C=C(\C)C#CC1=C(C)CC(O)CC1(C)C

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based on heuristic

inferred from InChI

Identifiers

InChI

InChI=1S/C40H54O/c1-30(18-13-20-32(3)23-25-37-34(5)22-15-27-39(37,7)8)16-11-12-17-31(2)19-14-21-33(4)24-26-38-35(6)28-36(41)29-40(38,9)10/h11-14,16-23,25,36-37,41H,15,27-29H2,1-10H3/b12-11+,18-13?,19-14+,25-23?,30-16?,31-17+,32-20?,33-21+

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InChIKey

UNFSUWGHNYXWHO-ACTXNLKDSA-N

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(Q105275957)

3,5,5-trimethyl-4-[(3E,5E,7E,9E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethylcyclohex-2-en-1-yl)octadeca-3,5,7,9,11,13,15,17-octaen-1-yn-1-yl]cyclohex-3-en-1-ol

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